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Home > Bromides > 1157455-49-6
1157455-49-6 | 2-Piperidinone, 1-(5-bromo-2-methylphenyl)-
CAS No: 1157455-49-6 Catalog No: AG000GT2 MDL No:MFCD12065861
Product Description
Catalog Number:
AG000GT2
Chemical Name:
2-Piperidinone, 1-(5-bromo-2-methylphenyl)-
CAS Number:
1157455-49-6
Molecular Formula:
C12H14BrNO
Molecular Weight:
268.1497
MDL Number:
MFCD12065861
IUPAC Name:
1-(5-bromo-2-methylphenyl)piperidin-2-one
InChI:
InChI=1S/C12H14BrNO/c1-9-5-6-10(13)8-11(9)14-7-3-2-4-12(14)15/h5-6,8H,2-4,7H2,1H3
InChI Key:
AOPGRXCHBRBXIZ-UHFFFAOYSA-N
SMILES:
Brc1ccc(c(c1)N1CCCCC1=O)C
Properties
Complexity:
244
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.026g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
268.154g/mol
Monoisotopic Mass:
267.026g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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